Molecular Properties | |
SMILES: | CCNc1ncc(C#N)cc1C(c1ccc(Br)s1)N1CCN(C(=O)CCl)CC1 |
MW: | 482.835 |
Fraction sp3: | 0.42 |
HBA: | 6 |
HBD: | 1 |
Rotatable Bonds: | 6 |
TPSA: | 72.26 |
cLogP: | 3.68148 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
Filter9_metal
aryl bromide
MED-COV-4280ac29-34
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PAU-WEI-f734c343-2
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PAU-UNI-52c0427f-1
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DAR-DIA-fb20be43-4
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DAR-DIA-fb20be43-3
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JOH-UNI-27ac80fd-25
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SEA-TRI-2c7f3de8-1
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MAK-UNK-ec98eaf6-22
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DAR-DIA-3e9bbd81-11
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DAR-DIA-fb20be43-1
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SEA-TRI-8222e606-1
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DAR-DIA-fb20be43-5
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SIM-SYN-f15aaa3a-2
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VIK-SYN-9a3d118a-8
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JAN-GHE-fd8d85a5-1
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DAV-CRI-d1e0885a-2
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MED-COV-4280ac29-6
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MAK-UNK-849bee6c-23
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MED-COV-4280ac29-24
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MED-COV-4280ac29-7
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MAK-UNK-987948f6-3
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MAK-UNK-6ca90168-14
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JAN-GHE-fd8d85a5-6
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JOH-UNI-27ac80fd-23
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NIM-UNI-05f93fcc-1
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MAT-POS-ee51dedd-1
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MAR-TRE-6a44bbf2-77
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MAK-UNK-516d8086-7
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MAK-UNK-af83ef51-20
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MAK-UNK-849bee6c-21
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JAN-GHE-fd8d85a5-5
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MAK-UNK-849bee6c-4
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MAK-UNK-849bee6c-16
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PAU-WEI-b9b69149-4
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MAK-UNK-6ca90168-7
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GIA-UNK-7337c2f3-6
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MAK-UNK-849bee6c-7
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THO-SYG-98fc3427-4
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